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1,6-Bis[(1R,2R)-2-tert-butoxycyclopropyl]hex-3-ene-1,5-diyne
SpectraBase Compound ID 4Zl5vwt39Aa
InChI InChI=1S/C20H28O2/c1-19(2,3)21-17-13-15(17)11-9-7-8-10-12-16-14-18(16)22-20(4,5)6/h7-8,15-18H,13-14H2,1-6H3/b8-7+/t15-,16-,17+,18+/m0/s1
InChIKey FQKJHKBVUVIVEB-XRJBRTOYSA-N
Mol Weight 300.44 g/mol
Molecular Formula C20H28O2
Exact Mass 300.20893 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8i234FAR8xW
Name 1,6-Bis[(1R,2R)-2-tert-butoxycyclopropyl]hex-3-ene-1,5-diyne
Comments Less than 3 mono-isotopic peaks
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Formula C20H28O2
InChI InChI=1S/C20H28O2/c1-19(2,3)21-17-13-15(17)11-9-7-8-10-12-16-14-18(16)22-20(4,5)6/h7-8,15-18H,13-14H2,1-6H3/b8-7+/t15-,16-,17+,18+/m0/s1
InChIKey FQKJHKBVUVIVEB-XRJBRTOYSA-N
Molecular Weight 300.442 g/mol
SMILES [C@]1([C@@](C#C\C=C\C#C[C@@]2([C@](OC(C)(C)C)(C2)[H])[H])(C1)[H])(OC(C)(C)C)[H]
SPLASH splash10-0a4i-9000000000-50cc93c7914f5cef248c
Source of Spectrum SO-0-587-22
Synonyms (1R,2R)-1-tert-butoxy-2-{(3E)-6-[(1R,2R)-2-tert-butoxycyclopropyl]-3-hexene-1,5-diynyl}cyclopropane
Wiley ID 1544844